N-[(4-phenoxyphenyl)carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[(4-phenoxyphenyl)carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[(4-phenoxyphenyl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[(4-phenoxyanilino)-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[(4-phenoxyphenyl)carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[(4-phenoxyphenyl)thiocarbamoyl]adamantane-1-carboxamide Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C24H26N2O2S/c27-22(24-13-16-10-17(14-24)12-18(11-16)15-24)26-23(29)25-19-6-8-21(9-7-19)28-20-4-2-1-3-5-20/h1-9,16-18H,10-15H2,(H2,25,26,27,29)